3-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 3-[[4-ethyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 3-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C14H18N4OS/c1-2-18-13(10-11-6-4-3-5-7-11)16-17-14(18)20-9-8-12(15)19/h3-7H,2,8-10H2,1H3,(H2,15,19)